4Y5D

CRYSTAL STRUCTURE OF ALiS2-STREPTAVIDIN COMPLEX

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL44XU
Synchrotron site	SPring-8
Beamline	BL44XU
Temperature [K]	100
Detector technology	CCD
Collection date	2013-11-11
Detector	MARRESEARCH
Wavelength(s)	0.80
Spacegroup name	P 1 21 1
Unit cell lengths	57.927, 83.774, 45.947
Unit cell angles	90.00, 98.75, 90.00

Refinement procedure

Resolution	50.000 - 1.200
R-factor	0.13951
Rwork	0.138
R-free	0.17376
RMSD bond length	0.022
RMSD bond angle	2.289
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0049)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.220
High resolution limit [Å]	1.200	1.200
Rmerge	0.081	0.370
Number of reflections	132391
<I/σ(I)>	7.9	1.7
Completeness [%]	98.1	95.5
Redundancy	3.1	2.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	293	0.1M Mes-NaOH (pH6.0), 45%(w/v) PEG1000